International Journal of Quantum Chemistry

Cover image for International Journal of Quantum Chemistry

January 1981

Volume 19, Issue 1

Pages fmi–fmii, 1–189

  1. Masthead

    1. Top of page
    2. Masthead
    3. Articles
    1. Masthead (pages fmi–fmii)

      Version of Record online: 19 OCT 2004 | DOI: 10.1002/qua.560190101

  2. Articles

    1. Top of page
    2. Masthead
    3. Articles
    1. Simple technique to obtain correlated energy curves: LiH calculations (pages 1–10)

      Federico Moscardó and Gerardo Delgado-Barrio

      Version of Record online: 19 OCT 2004 | DOI: 10.1002/qua.560190102

    2. Simple relationship between total molecular correlation energies and LMO sizes (pages 25–31)

      M. R. Peterson, R. A. Poirier, R. Daudel and I. G. Csizmadia

      Version of Record online: 19 OCT 2004 | DOI: 10.1002/qua.560190104

    3. Nonconservation of excitons as a mechanism of light-energy capturing (pages 33–42)

      E. A. Hadžiselimović, M. M. Marinković and B. S. Tošić

      Version of Record online: 19 OCT 2004 | DOI: 10.1002/qua.560190105

    4. The graph center concept for polycyclic graphs (pages 61–82)

      Danail Bonchev, Alexandru T. Balaban and Milan Randić

      Version of Record online: 19 OCT 2004 | DOI: 10.1002/qua.560190107

    5. Geometry of a quantal system (pages 83–93)

      Máximo García-Sucre and Mario Bunge

      Version of Record online: 19 OCT 2004 | DOI: 10.1002/qua.560190108

    6. Combination of pseudopotentials and density functionals (pages 113–130)

      H. Preuss, H. Stoll, U. Wedig and Th. Krüger

      Version of Record online: 19 OCT 2004 | DOI: 10.1002/qua.560190111

    7. Scaled single-zeta basis set for use with a silicon effective potential: Generalized valence bond description of disilane (pages 131–137)

      Jules W. Moskowitz, Sid Topiol, Lawrence C. Snyder and Mark A. Ratner

      Version of Record online: 19 OCT 2004 | DOI: 10.1002/qua.560190112

    8. Uracil and the tautomer 4-hydroxyuracil: An ab initio study with geometry optimization (pages 171–177)

      Theresa Julia Zielinski, Masayuki Shibata and Robert Rein

      Version of Record online: 19 OCT 2004 | DOI: 10.1002/qua.560190115

    9. Calculation of isoelectronic energy differences using perturbation theory (pages 179–189)

      Stephen F. Sontum, Lloyd L. Ingraham and William H. Fink

      Version of Record online: 19 OCT 2004 | DOI: 10.1002/qua.560190116

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